Vitas-M small molecule compound
(2S,5aR,6aR,9S,9aR)-9-((3,3-dimethylpiperidin-1-yl)methyl)-2,5a-dimethyloctahydro-2H-oxireno[2',3':4,4a]naphtho[2,3-b]furan-8(9bH)-one
Catalog ID
STL547224
SMILES O=C1O[C@H]2[C@@H](C1CN1CCCC(C1)(C)C)C1OC31[C@](C2)(C)CCC[C@@H]3C
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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.
We do not supply quantities above 5 g.
Structure and other identifiers
2D representation rendered from the SMILES, with core physicochemical data.Formula C22H35NO3 MW 361.52 g/mol Purity >90% as per NMR
InChI
InChI=1S/C22H35NO3/c1-14-7-5-9-21(4)11-16-17(18-22(14,21)26-18)15(19(24)25-16)12-23-10-6-8-20(2,3)13-23/h14-18H,5-13H2,1-4H3/t14-,15?,16+,17+,18?,21+,22?/m0/s1InChIKey
AWARIKSVYAKVLG-DJBSVUAOSA-NSynonyms
1212448-74-2(2S5aR6aR9S9aR)9((33dimethylpiperidin1yl)methyl)25adimethyloctahydro2Hoxireno(2344a)naphtho(23b)furan8(9bH)one
(4~(R)8~(R)10~(R)14~(S))5((33dimethylpiperidin1yl)methyl)1014dimethyl27dioxatetracyclo(8400^(13)0^(48))tetradecan6one
1212448742
16396424
InChI=1SC22H35NO3c11475921(4)111617(1822(1421)2618)15(19(24)2516)1223106820(23)1323h1418H513H214H3t1415?16+17+18?21+22?m0s1
O=C1O(C@H)2(C@@H)(C1CN1CCCC(C1)(C)C)C1OC31(C@)(C2)(C)CCC(C@@H)3C
ZINC000004027410
ZINC000106899628
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